N-[2-methoxy-4-(4-thiophen-2-ylbutanoylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[2-methoxy-4-(4-thiophen-2-ylbutanoylamino)phenyl]pyridine-3-carboxamide Openeye Name: N-[2-methoxy-4-[4-(2-thienyl)butanoylamino]phenyl]pyridine-3-carboxamide CAS Name: N-[2-methoxy-4-[(1-oxo-4-thiophen-2-ylbutyl)amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-methoxy-4-(4-thiophen-2-ylbutanoylamino)phenyl]pyridine-3-carboxamide Traditional Name: N-[2-methoxy-4-[4-(2-thienyl)butanoylamino]phenyl]nicotinamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCCC2=CC=CS2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCCC2=CC=CS2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-27-19-13-16(23-20(25)8-2-6-17-7-4-12-28-17)9-10-18(19)24-21(26)15-5-3-11-22-14-15/h3-5,7,9-14H,2,6,8H2,1H3,(H,23,25)(H,24,26)